Isopropanol → HCID 178503438, compound
Reaction equation
[CH3:19][N:20]([CH2:21][CH2:22][NH2:23])[CH3:24].[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH3:32][CH:33]([OH:34])[CH3:35].[Cl:1][c:2]1[n:3][cH:4][c:5]2[c:6]([n:7]1)[nH:8][n:9][c:10]2-[c:11]1[n:12][c:13]([S:17][CH3:18])[n:14][cH:15][cH:16]1>>[c:2]1([NH:23][CH2:22][CH2:21][N:20]([CH3:19])[CH3:24])[n:3][cH:4][c:5]2[c:6]([n:7]1)[nH:8][n:9][c:10]2-[c:11]1[n:12][c:13]([S:17][CH3:18])[n:14][cH:15][cH:16]1Participants
5
Sources & evidence
- ORD record
- ord-bb6f78be69a0410b8b8c46f0794a60bd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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